Urs-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-, 6-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (3β)-

CAS Registry Number®

164178-29-4

CAS Name

Urs-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-, 6-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (3β)-

Molecular Formula

C59H96O26

Molecular Mass

1221.38

Cite this Page

Urs-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-, 6-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (3β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=164178-29-4 (retrieved 2024-11-12) (CAS RN: 164178-29-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C59H96O26/c1-23-11-16-59(54(75)85-52-46(74)42(70)38(66)30(81-52)22-77-49-43(71)40(68)36(64)28(19-60)79-49)18-17-57(7)26(34(59)24(23)2)9-10-32-56(6)14-13-33(55(4,5)31(56)12-15-58(32,57)8)82-53-48(84-50-44(72)39(67)35(63)25(3)78-50)47(27(62)21-76-53)83-51-45(73)41(69)37(65)29(20-61)80-51/h9,23-25,27-53,60-74H,10-22H2,1-8H3

InChIKey

InChIKey=KIDKFTVXSGGWRY-UHFFFAOYSA-N

SMILES

C(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)(=O)C34C(C=5C(C)(CC3)C6(C)C(CC5)C7(C)C(CC6)C(C)(C)C(OC8C(OC9C(O)C(O)C(O)C(C)O9)C(OC%10OC(CO)C(O)C(O)C%10O)C(O)CO8)CC7)C(C)C(C)CC4

Canonical SMILES

O=C(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)C34CCC(C)C(C)C4C5=CCC6C7(C)CCC(OC8OCC(O)C(OC9OC(CO)C(O)C(O)C9O)C8OC%10OC(C)C(O)C(O)C%10O)C(C)(C)C7CCC6(C)C5(C)CC3

Other Names for this Substance

  • Urs-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-, 6-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (3β)-
  • Matesaponin 4

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles